(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)methyl 2-[(4-cyanophenyl)sulfonylamino]ethanoate

Systemtic Name: (3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)methyl 2-[(4-cyanophenyl)sulfonylamino]ethanoate Openeye Name: [3-(3-thienyl)-1,2,4-oxadiazol-5-yl]methyl 2-[(4-cyanophenyl)sulfonylamino]acetate CAS Name: 2-[(4-cyanophenyl)sulfonylamino]acetic acid [3-(3-thiophenyl)-1,2,4-oxadiazol-5-yl]methyl ester IUPAC Name: (3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)methyl 2-[(4-cyanophenyl)sulfonylamino]acetate Traditional Name: 2-[(4-cyanophenyl)sulfonylamino]acetic acid [3-(3-thienyl)-1,2,4-oxadiazol-5-yl]methyl ester Formula: C16H12N4O5S2 MolecularWeight: 404.42028

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)S(=O)(=O)NCC(=O)OCC2=NC(=NO2)C3=CSC=C3

Isomeric SMILES

C1=CC(=CC=C1C#N)S(=O)(=O)NCC(=O)OCC2=NC(=NO2)C3=CSC=C3

InChI

InChI=1S/C16H12N4O5S2/c17-7-11-1-3-13(4-2-11)27(22,23)18-8-15(21)24-9-14-19-16(20-25-14)12-5-6-26-10-12/h1-6,10,18H,8-9H2